lundi 30 mai 2022
Heures | événement | (+) |
09:30 - 10:00 | Accueil et café/thé (Hall Physique) | |
10:00 - 10:50 | The stressed solvent: THz calorimetry probing the solvent in action (Salle E244) - Martina Havenith | |
10:50 - 11:15 | Second harmonic scattering: access to the orientational structure of water (Salle E244) - Julien Duboisset | |
11:15 - 11:40 | How to interpret the Second Harmonic Scattering of liquid water? (Salle E244) - Guillaume le Breton | |
11:40 - 12:05 | Horizontal and vertical orders of water at mineral interfaces: a new paradigm for the BIL structural organization (Salle E244) - Marie-Pierre Gaigeot | |
12:05 - 12:30 | Towards a microscopic understanding of underscreening in concentrated electrolytes: Effects of confinement and composition fluctuations (Salle E244) - Jeongmin Kim | |
12:30 - 14:00 | Déjeuner | |
14:00 - 14:50 | Continuum solvation models for electronic dynamics and excitations in molecular solutes (Salle E244) - Stefano Corni | |
14:50 - 15:15 | Tuning the optical properties of nanoconfined chromophores: a molecular understanding of environment effects (Salle E244) - Abderrahmane Semmeq | |
15:15 - 15:40 | Coupling electronic and molecular Density Functional Theory (Salle E244) - Guillaume Jeanmairet/Daniel Borgis | |
15:40 - 16:05 | Adsorption of ions and hydrophobic solutes at an electrified Au-water interface: insights from THz spectroscopy and simulations - Simone Pezzotti | |
16:05 - 16:35 | Pause café (Hall Physique) | |
16:35 - 17:00 | Electron Transfer of Functionalized Quinones in Acetonitrile (Salle E244) - Tzu-Yao Hsu | |
17:00 - 17:25 | Transport properties and ion aggregation of SBPBF4 in acetonitrile solutions: experiment vs. molecular modelling (Salle E244) - Oleg Kalugin | |
17:25 - 18:15 | Round table: The future of SolVATE (Salle E244) - All | |
18:45 - 21:00 | Dîner buffet (Hall Physique) |
mardi 31 mai 2022
Heures | événement | (+) |
09:00 - 09:50 | Electrons in Liquid Ammonia and in Water: From Blue Electrolytes to Golden Metals (Salle E244) - Pavel Jungwirth | |
09:50 - 10:15 | Toward a molecular picture of thermophoresis in dilute aqueous solutions (Salle E244) - Guillaume Stirnemann | |
10:15 - 10:40 | Origin of the second harmonic generation signal at the water-air interface (Salle E244) - Jean-François Dufrêche | |
10:40 - 11:10 | Pause café (Hall Physique) | |
11:10 - 11:35 | Hydration dynamics of nucleic acids: molecular origin of the heterogeneity and sequence dependence (Salle E244) - Elise Duboué-Dijon | |
11:35 - 12:00 | Molecular dynamics simulation study of the association modes between calcium and polygalacturonate (Salle E244) - Adrien Lerbret | |
12:00 - 12:25 | Solubilization of aromas by cyclic and acyclic dextrins based DES: A comparative study (Salle E244) - Sophie Fourmentin | |
12:25 - 13:30 | Déjeuner (Hall Physique) | |
13:30 - 14:20 | What circular dichroism spectroscopy teach us about solvation (Salle E244) - Anne Zehnacker | |
14:20 - 14:45 | Tuning the properties of ionene-based hydrogels via counterion specific effects (Salle E244) - Natalie Malikova | |
14:45 - 15:10 | Quadrupolar NMR relaxation for ions in aqueous solutions from classical molecular dynamics (Salle E244) - Iurii Chubak | |
15:10 - 15:35 | Structure and dynamics of an excess proton in water: a neural network force-field study (Salle E244) - Axel Gomez | |
15:35 - 16:00 | Transmembrane electron transfer in NADPH Oxydase (Salle E244) - Fabien Cailliez | |
16:00 - 16:25 | Diastereoselectivity in Diels-Alder reactions in solution + CECAM words (Salle E244) - Riccardo Spezia | |
16:25 - 16:35 | Closing words (Salle E244) - Francesca Ingrosso |